AN-465/12944044
TL;DR: AN-465/12944044 (CAS 353489-28-8) is a chemical compound with molecular formula C22H22N4OS and molecular weight 390.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[4-(dimethylamino)phenyl]-2-phenyl-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone
Also Known As: AN-465/12944044, 1-[4-(4-dimethylaminophenyl)-2-phenyl-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone, 1-(4-(4-(dimethylamino)phenyl)-1-phenyl-5-(thiophen-2-yl)-4,5-dihydro-1H-1,2,4-triazol-3-yl)ethanone, 1-[4-(4-Dimethylamino-phenyl)-1-phenyl-5-thiophen-2-yl-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-ethanone, 1-[4-[4-(dimethylamino)phenyl]-1-phenyl-5-(2-thienyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone
| Molecular Formula | C22H22N4OS |
|---|---|
| Molecular Weight | 390.15 g/mol |
| LogP | 4.742 |
| Topological Polar Surface Area | 39.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.15143 |
| Heavy Atoms | 28 |
| Complexity | 981.1458 |
Chemical Identifiers
| CAS Number | 353489-28-8 |
|---|---|
| SMILES | CC(=O)C1=NN(C(N1C2=CC=C(C=C2)N(C)C)C3=CC=CS3)C4=CC=CC=C4 |
Product Overview
AN-465/12944044 (CAS 353489-28-8), with molecular formula C22H22N4OS and molecular weight 390.15 g/mol. IUPAC: 1-[4-[4-(dimethylamino)phenyl]-2-phenyl-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone.
Chemical Property Profile of AN-465/12944044
Property Insights of AN-465/12944044
The XLogP value of 4.742 indicates that AN-465/12944044 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.15 Ų, AN-465/12944044 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-465/12944044 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-465/12944044?
The CAS number of AN-465/12944044 is 353489-28-8.
What is the molecular formula of AN-465/12944044?
The molecular formula of AN-465/12944044 is C22H22N4OS.
What is the molecular weight of AN-465/12944044?
The molecular weight of AN-465/12944044 is 390.15 g/mol.
Where can I buy AN-465/12944044?
You can request a quote for AN-465/12944044 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/12944044?
Yes, KEHONG BIO provides custom synthesis services for AN-465/12944044 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.